7S99

Room-temperature Human Hsp90a-NTD bound to N6M

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	278
Detector technology	PIXEL
Collection date	2020-09-01
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	I 2 2 2
Unit cell lengths	65.769, 89.670, 101.283
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.630 - 1.520
R-factor	0.1677
Rwork	0.167
R-free	0.18090
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yer
RMSD bond length	0.008
RMSD bond angle	0.818
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19rc5_4047)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.630	1.570
High resolution limit [Å]	1.520	1.520
Rmerge	0.078
Number of reflections	45144	4428
<I/σ(I)>	10.15
Completeness [%]	96.2
Redundancy	4.6
CC(1/2)	0.993	0.605

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	1.8 M Malic acid, pH 7